[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C24H21ClN6O MolecularWeight: 444.91614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C24H21ClN6O/c25-19-9-7-18(8-10-19)22-21(17-31(28-22)20-5-2-1-3-6-20)23(32)29-13-15-30(16-14-29)24-26-11-4-12-27-24/h1-12,17H,13-16H2